Methanenitronate
TL;DR: Methanenitronate (CAS 54898-73-6) is a chemical compound with molecular formula CH2NO2- and molecular weight 60.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
nitromethane
Also Known As: Methanenitronate, nitromethanide, nitronate, NITROMETHANE, Nitromethaneanion
| Molecular Formula | CH2NO2- |
|---|---|
| Molecular Weight | 60.01 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 60.008553 |
| Heavy Atoms | 4 |
| Complexity | 27.0 |
Chemical Identifiers
| CAS Number | 54898-73-6 |
|---|---|
| SMILES | [CH2-][N+](=O)[O-] |
| InChIKey | FMXOEQQPVONPBU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methanenitronate (CAS 54898-73-6), with molecular formula CH2NO2- and molecular weight 60.01 g/mol. IUPAC: nitromethane.
Chemical Property Profile of Methanenitronate
Property Insights of Methanenitronate
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methanenitronate. With a topological polar surface area (TPSA) of 45.8 Ų, Methanenitronate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methanenitronate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methanenitronate?
The CAS number of Methanenitronate is 54898-73-6.
What is the molecular formula of Methanenitronate?
The molecular formula of Methanenitronate is CH2NO2-.
What is the molecular weight of Methanenitronate?
The molecular weight of Methanenitronate is 60.01 g/mol.
Where can I buy Methanenitronate?
You can request a quote for Methanenitronate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanenitronate?
Yes, KEHONG BIO provides custom synthesis services for Methanenitronate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.